%chk=000035222.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035222

0 1
 O    4.354900       4.798300     -0.3165000    
 O    4.249400      -4.884200     -0.4153000    
 O    4.278700       2.682500     -0.8971000    
 O    4.218300      -2.756800     -0.9558000    
 N   0.3504000     -6.3000000E-03  0.3288000    
 N   -1.722000      -1.181800      4.4000000E-02
 N   -1.696700       1.217600      6.6000000E-02
 N    3.739500       3.709700     -0.4190000    
 N    3.657800      -3.780600     -0.4955000    
 C   0.3578000       2.362300      0.3475000    
 C   0.3079000      -2.374600      0.3043000    
 C  -0.3688000       1.124300      0.2417000    
 C  -0.3924000      -1.119700      0.2212000    
 C   -2.299700      2.4800001E-02 -2.3499999E-02
 C   -3.733900      4.1600000E-02 -0.2143000    
 C    1.686000       2.438500     -8.3499998E-02
 C    1.633400      -2.471400     -0.1311000    
 C  -0.2583000       3.497700      0.8835000    
 C  -0.3321000      -3.506300      0.8195000    
 C    2.390900       3.637800      2.0300001E-02
 C    2.311900      -3.687600     -5.2000001E-02
 C   -4.334400       1.100500     -0.8954000    
 C   -4.516100      -1.001100      0.2824000    
 C   0.4465000       4.696900      0.9873000    
 C   0.3463000      -4.722300      0.8986000    
 C    1.771000       4.766900      0.5556000    
 C    1.668300      -4.813100      0.4629000    
 C   -5.716900       1.116900      -1.079600    
 C   -5.898600     -0.9848000      9.7999997E-02
 C   -6.499000      7.4299999E-02 -0.5830000    
 H    2.162500       1.558100     -0.5105000    
 H    2.128200      -1.593700     -0.5423000    
 H   -1.286300       3.473700       1.237700    
 H   -1.358900      -3.466600       1.175900    
 H  -3.5500001E-02   5.575400       1.406200    
 H  -0.1541000      -5.598100       1.301300    
 H   -3.751500       1.923000      -1.302800    
 H   -4.079400      -1.835700      0.8257000    
 H    2.288900       5.717700      0.6524000    
 H    2.165500      -5.776600      0.5402000    
 H   -6.184500       1.940200      -1.611600    
 H   -6.508300      -1.795400      0.4864000    
 H   -7.575500      8.6900003E-02 -0.7264000    


%chk=000035222-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035222

0 1
O 4.588912 4.795966 0.091357
O 4.465044 -4.910144 0.291418
O 4.583844 2.515521 0.128545
O 4.517176 -2.630233 0.257523
N 0.353716 -0.006053 0.088917
N -1.758558 -1.189710 0.059404
N -1.727713 1.229134 0.017071
N 3.983335 3.655430 0.097382
N 3.888398 -3.755223 0.256348
C 0.395630 2.443298 0.043713
C 0.333318 -2.455637 0.132652
C -0.360517 1.163852 0.050321
C -0.390105 -1.158030 0.091858
C -2.395189 0.027750 0.022855
C -3.874869 0.046101 -0.011454
C 1.811491 2.432249 0.073816
C 1.748736 -2.479249 0.173654
C -0.297966 3.683126 0.006758
C -0.391425 -3.678067 0.131003
C 2.494617 3.661776 0.066027
C 2.400290 -3.725239 0.212113
C -4.574915 1.282843 -0.048963
C -4.606837 -1.172605 -0.006590
C 0.413051 4.901135 -0.000034
C 0.288271 -4.913223 0.169587
C 1.823436 4.904046 0.029694
C 1.697887 -4.950681 0.210934
C -5.983396 1.298296 -0.081118
C -6.015281 -1.152641 -0.038932
C -6.707757 0.081761 -0.076174
H 2.359890 1.487888 0.102546
H 2.320641 -1.548490 0.175529
H -1.391030 3.664540 -0.016063
H -1.483477 -3.632555 0.099305
H -0.130155 5.850733 -0.028536
H -0.278699 -5.849258 0.167906
H -3.998072 2.212012 -0.052164
H -4.054253 -2.115947 0.022675
H 2.404851 5.829723 0.025386
H 2.255640 -5.890303 0.241902
H -6.518592 2.253443 -0.109991
H -6.575076 -2.094019 -0.034931
H -7.803094 0.095584 -0.101046


